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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03399480

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EOD11-[(2R,3S)-3-PENTYLOXIRAN-2-YL]UNDECANOIC ACIDA,B,C2DIO0.73
6OB(8E,10S,12Z)-10-hydroxy-6-oxooctadeca-
8,12-dienoic acid		A,B2VV40.84
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B2RCL0.94
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B3DSK0.94
ELA9-OCTADECENOIC ACIDA1HMR0.79
EICLINOLEIC ACIDA2Q9S0.79
EICLINOLEIC ACIDA2EVL0.79
EICLINOLEIC ACIDA1IGZ0.79
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.79
LNLALPHA-LINOLENIC ACIDA2BYO0.78
LNLALPHA-LINOLENIC ACIDA1FK60.78
PGW(1R)-2-{[(S)-{[(2S)-2,3-dihydroxypropyl]oxy}(hydroxy)phosphoryl]oxy}-
1-[(hexadecanoyloxy)methyl]ethyl (9Z)-
octadec-9-enoate		A,B,G,H2R9R0.73
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID		A,B2G5W0.71
OLAOLEIC ACIDA1VYF0.79
OLAOLEIC ACIDA2EV40.79
OLAOLEIC ACIDA1FK50.79
OLAOLEIC ACIDA1FE30.79
OLAOLEIC ACIDA,B2AG40.79
OLAOLEIC ACIDA,B1J780.79
OLAOLEIC ACIDA2E9L0.79
OLAOLEIC ACIDA,B2EV10.79
OLAOLEIC ACIDA1GNI0.79
OLAOLEIC ACIDA1SX60.79
OLAOLEIC ACIDA2E9M0.79
OLAOLEIC ACIDA2FLJ0.79
OLAOLEIC ACIDA2ZOX0.79
OLAOLEIC ACIDA2AF90.79
OLAOLEIC ACIDA,B,C2AG20.79
OLAOLEIC ACIDA2JU80.79
OLAOLEIC ACIDA,B1GT60.79
OLAOLEIC ACIDA,B,C1PMP0.79
OLAOLEIC ACIDA,B1DKF0.79
OLAOLEIC ACIDA1ICN0.79
OLAOLEIC ACIDA1G740.79
OLAOLEIC ACIDA,B1J7E0.79
OLAOLEIC ACIDA1LFO0.79
OLAOLEIC ACIDA1HMS0.79
OLAOLEIC ACIDA2EV30.79
OLAOLEIC ACIDA2EV20.79
OLAOLEIC ACIDA2FTB0.79
OLAOLEIC ACIDA1LID0.79
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.84
PAMPALMITOLEIC ACIDA,B,C,D1SMJ0.78
PAMPALMITOLEIC ACIDA,B,C1IZO0.78
PAMPALMITOLEIC ACIDA,B,C,D1FAG0.78
PAMPALMITOLEIC ACIDA1FK30.78
PAMPALMITOLEIC ACIDA,B3EKD0.78
PAMPALMITOLEIC ACIDA2UUH0.78
PAMPALMITOLEIC ACIDA,B1YH80.78
PAMPALMITOLEIC ACIDA,B1YHC0.78
PAMPALMITOLEIC ACIDA1UVB0.78
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.84
MPG1-MONOOLEOYL-RAC-GLYCEROLA2GUF0.71
MPG1-MONOOLEOYL-RAC-GLYCEROLA,B1E120.71
4HD(4S,5E,7Z,10Z,13Z,16Z,19Z)-4-hydroxydocosa-
5,7,10,13,16,19-hexaenoic acid		A,B2VV10.71
T24(9Z,11E,13S,15Z)-13-hydroxyoctadeca-
9,11,15-trienoic acid		A,B3DSI0.84
4R8(6E,10Z,13Z,16Z,19Z)-4-oxodocosa-
6,10,13,16,19-pentaenoic acid		A2VV30.71
VCAVACCENIC ACIDA,B2BAW0.79
VCAVACCENIC ACIDA,B2B500.79
VCAVACCENIC ACIDB2ACO0.79
VCAVACCENIC ACIDA,B2AWH0.79
RCLRICINOLEIC ACIDA2CM40.86
RCLRICINOLEIC ACIDA2CM90.86
RCLRICINOLEIC ACIDA1FK70.86
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID		A1IK30.95
PG2PROSTAGLANDIN D2A,B1RY00.71
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B3DSJ0.84
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2RCH0.84
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2VST0.84
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.77
P0EPHOSPHATIDYL ETHANOLA1YOW0.71
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2DYS0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B2IRV0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2EIL0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2DYR0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2EIM0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z		1V550.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z		2EIN0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z		2EIK0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z		1V540.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z		2ZXW0.73
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z		2EIJ0.73
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.84
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.79
PVC(2E,4R,5S)-2,3,4,5-TETRAHYDROXY-
6-(PALMITOYLOXY)HEX-2-ENOIC ACID		A1W3Y0.71
OLC(2R)-2,3-dihydroxypropyl (9Z)-octadec-
9-enoate		A3D4S0.81
DR91-CIS-9-OCTADECANOYL-2-CIS-9-HEXADECANOYL PHOSPHATIDYL GLYCEROLA1YMT0.73
P3APHOSPHATIDYLGLYCEROL-PHOSPHOGLYCEROLA1ZDU0.72
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.8
EAH(5S,7E,9E,11Z,14Z)-5-hydroxyicosa-
7,9,11,14-tetraenoic acid		A3DZT0.77
P6L(2S)-3-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
2-[(6E)-HEXADEC-6-ENOYLOXY]PROPYL (8E)-
OCTADEC-8-ENOATE		A1YOK0.73
6OC(8R,9Z,12Z)-8-hydroxy-6-oxooctadeca-
9,12-dienoic acid		A,B2VV40.8
MRCMUPIROCINA1JZS0.73
MRCMUPIROCINA,T1FFY0.73
MRCMUPIROCINA1QU30.73
MRCMUPIROCINA,T1QU20.73
11O(TRANS-12,13-EPOXY)-11-HYDROXY-
9(Z)-OCTADECENOIC ACID		A1IK30.87
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE		A,B2HFK0.7
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A3DBM0.84
5HE(5R,6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa-
6,8,11,14,17-pentaenoic acid		A,B2VV20.72
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.75